BDBM15368 3-(5-Chloro-2,4-dihydroxyphenyl)-4-(4-methoxyphenyl)-1H-pyrazole-5-carboxylic acid::CCT018159 analog 7

SMILES: COc1ccc(cc1)-c1c([nH]nc1-c1cc(Cl)c(O)cc1O)C(O)=O

InChI Key: InChIKey=VIBPEGKTQCWOSK-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 15368   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Heat shock protein HSP 90-beta (Homo sapiens (Human))	BDBM15368 (3-(5-Chloro-2,4-dihydroxyphenyl)-4-(4-methoxypheny...) Show SMILES COc1ccc(cc1)-c1c([nH]nc1-c1cc(Cl)c(O)cc1O)C(O)=O Show InChI InChI=1S/C17H13ClN2O5/c1-25-9-4-2-8(3-5-9)14-15(19-20-16(14)17(23)24)10-6-11(18)13(22)7-12(10)21/h2-7,21-22H,1H3,(H,19,20)(H,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	7.4	22
Vernalis (R&D) Ltd					Assay Description The assay is based upon displacement of a fluorescently labeled molecule, which binds specifically to the ATP-binding site of full-length human Hsp90...				J Med Chem 48: 4212-5 (2005) Article DOI: 10.1021/jm050355z BindingDB Entry DOI: 10.7270/Q2WQ0216
					More data for this Ligand-Target Pair